Geometry & MOs

Info

ID:	317404
PubChem CID:	126637284
Reduced:	ClFN5H21C22 (1)
Stoich.:	ABC5D21E22 (1)
Weight, g/mol:	132.075057
ΔH_f, kcal/mol:	34.24
Dipole, Da:	4.72
IP(EA), eV:	-8.87(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-difluorocycloheptene

Drug info:

PubChemData

Smile

C1CC(CC1CCC2=CC3=NC(=C(C=C3C=C2)F)N)N4C=CC5=C4N=CN=C5Cl

DOS

IR

Vibrations